Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL17386220 | 1.00 | CYP1A2 (0.47) | CYP1A2CYP3A4LMNAMAOAMAPT | |
| SCHEMBL3739339 | 1.00 | CYP1A2 (0.47) | CYP1A2CYP3A4LMNAMAOAMAPT | |
| SCHEMBL3741023 | 1.00 | CYP1A2 (0.47) | CYP1A2CYP3A4LMNAMAOAMAPT | |
| SCHEMBL15977387 | 0.87 | ALDH1A1 (0.55) | CYP1A2CYP3A4LMNAMAPTPKM | |
| SCHEMBL15235893 | 0.87 | ALDH1A1 (0.55) | CYP1A2CYP3A4LMNAMAPTPKM | |
| SCHEMBL6082774 | 0.87 | ALDH1A1 (0.55) | CYP1A2CYP3A4LMNAMAPTPKM | |
| SCHEMBL433974 | 0.86 | MAPT (0.47) | CYP1A2CYP3A4LMNAMAPTPKM | |
| SCHEMBL15428491 | 0.86 | MAPT (0.47) | CYP1A2CYP3A4LMNAMAPTPKM | |
| SCHEMBL14244289 | 0.86 | MAPT (0.47) | CYP1A2CYP3A4LMNAMAPTPKM | |
| SCHEMBL28600953 | 0.86 | MAPT (0.47) | CYP1A2CYP3A4LMNAMAPTPKM |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2794569-B1 | HETEROCYCLIC UREA COMPOUNDS | BIOTA EUROPE LTD (GB) | 2017-05-10 | — | — | EP | disclosed |